| SpectraBase Spectrum ID |
gbShF4Crqt |
| Name |
6-(p-Tolyloxy)-alpha,alpha,alpha-trifluoro-m-toluidine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.087098498 u |
| Formula |
C14H12F3NO |
| InChI |
InChI=1S/C14H12F3NO/c1-9-2-5-11(6-3-9)19-13-7-4-10(8-12(13)18)14(15,16)17/h2-8H,18H2,1H3 |
| InChIKey |
FFVRPABHQMXFCC-UHFFFAOYSA-N |
| Molecular Weight |
267.251 g/mol |
| SMILES |
NC=1C=C(C=CC1OC=1C=CC(=CC1)C)C(F)(F)F |
| Spectrum/Structure Validation Score (Raman) |
0.721524 |
